4-Chloro-2-(trichloromethyl)-8-(trifluoromethyl)quinoline

Base Information

• Chemical Name: 4-Chloro-2-(trichloromethyl)-8-(trifluoromethyl)quinoline
• CAS No.: 91991-76-3
• Molecular Formula: C₁₁H₄Cl₄F₃N
• Molecular Weight: 348.967
• Hs Code.: 2933499090
• European Community (EC) Number: 809-602-5
• DSSTox Substance ID: DTXSID70575957
• Nikkaji Number: J406.985D
• Wikidata: Q82465443
• Mol file: 91991-76-3.mol

Synonyms:91991-76-3;4-Chloro-2-trichloromethyl-8-trifluoromethyl-quinoline;4-chloro-2-(trichloromethyl)-8-(trifluoromethyl)quinoline;SCHEMBL9493489;DTXSID70575957;LJQTYYBJSXXNTO-UHFFFAOYSA-N;MFCD02179716;AB11421;CS-0458000;4-Chloro-2-trichloromethyl-8-(trifluoromethyl)quinoline;4-Chloro-2-trichloromethyl-8-trifluoromethyl-quinoline, AldrichCPR

Chemical Property of 4-Chloro-2-(trichloromethyl)-8-(trifluoromethyl)quinoline

Chemical Property:

• Vapor Pressure: 0.000156mmHg at 25°C
• Melting Point: 84-86 °C
• Refractive Index: 1.58
• Boiling Point: 341.8°Cat760mmHg
• PKA: -2.68±0.61(Predicted)
• Flash Point: 160.5°C
• PSA: 12.89000
• Density: 1.634g/cm³
• LogP: 5.73370
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 348.902044
• Heavy Atom Count: 19
• Complexity: 331

Purity/Quality:

98%min ^*data from raw suppliers

4-Chloro-2-trichloromethyl-8-trifluoromethyl-quinoline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2Cl)C(Cl)(Cl)Cl

Technology Process of 4-Chloro-2-(trichloromethyl)-8-(trifluoromethyl)quinoline

There total 2 articles about 4-Chloro-2-(trichloromethyl)-8-(trifluoromethyl)quinoline which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

antimony-penta-fluoride + 2,8-bis-(Trichloromethyl)-4-chloro-quinoline (91991-88-7) → 2-trichloromethyl-8-trifluoromethyl-4-chloro-quinoline (91991-76-3)

Guidance literature:

With hydrogenchloride; In dichloromethane;

Reference yield:

→ 2-trichloromethyl-8-trifluoromethyl-4-chloro-quinoline (91991-76-3)

Guidance literature:

upstream raw materials:

2,8-bis-(Trichloromethyl)-4-chloro-quinoline